Vitas-M small molecule compound
ethyl {4-[(Z)-2-cyano-2-(5,6-dimethyl-1H-benzimidazol-2-yl)ethenyl]phenoxy}acetate
Catalog ID
STL417581
SMILES CCOC(=O)COc1ccc(cc1)/C=C(\c1[nH]c2c(n1)cc(c(c2)C)C)/C#N
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C22H21N3O3 MW 375.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O3/c1-4-27-21(26)13-28-18-7-5-16(6-8-18)11-17(12-23)22-24-19-9-14(2)15(3)10-20(19)25-22/h5-11H,4,13H2,1-3H3,(H,24,25)/b17-11-InChIKey
HLSJQOZLTLAVGO-BOPFTXTBSA-NSynonyms
CCOC(=O)COC1=CC=C(C=C1)C=C(C#N)C2=NC3=C(N2)C=C(C(=C3)C)C
CCOC(=O)COc1ccc(cc1)C=C(c1(nH)c2c(n1)cc(c(c2)C)C)C#N
ethyl(4((Z)2cyano2(56dimethyl1Hbenzimidazol2yl)ethenyl)phenoxy)acetate
ETHYL2(4((Z)2CYANO2(56DIMETHYL1HBENZIMIDAZOL2YL)ETHENYL)PHENOXY)ACETATE
InChI=1SC22H21N3O3c142721(26)1328187516(6818)1117(1223)222419914(2)15(3)1020(19)2522h511H413H213H3(H2425)b1711
MFCD06628969
ZINC000004756181
ZINC04756181
ZINC4756181
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